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CHEBI:83583 - 1,1',2-trilinoleoyl-2'-palmitoyl cardiolipin(2−)

ChEBI IDCHEBI:83583
ChEBI Name1,1',2-trilinoleoyl-2'-palmitoyl cardiolipin(2−)
Stars
ASCII Name1,1',2-trilinoleoyl-2'-palmitoyl cardiolipin(2-)
DefinitionA cardiolipin 70:6(2−) obtained by deprotonation of the phosphate OH groups of 1,1',2-trilinoleoyl-2'-palmitoyl cardiolipin; major species at pH 7.3.
Last Modified20 January 2015
Submitterlaimo
DownloadsMolfile
FormulaC79H140O17P2
Net Charge-2
Average Mass1423.920
Monoisotopic Mass1422.95767
SMILESCCCCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC(O)COP(=O)([O-])OC[C@@H](COC(=O)CCCCCCC/C=C\C/C=C\CCCCC)OC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCCCCC/C=C\C/C=C\CCCCC
InChIInChI=1S/C79H142O17P2/c1-5-9-13-17-21-25-29-33-36-40-43-47-51-55-59-63-76(81)89-69-74(95-78(83)65-61-57-53-49-45-39-32-28-24-20-16-12-8-4)71-93-97(85,86)91-67-73(80)68-92-98(87,88)94-72-75(96-79(84)66-62-58-54-50-46-42-38-35-31-27-23-19-15-11-7-3)70-90-77(82)64-60-56-52-48-44-41-37-34-30-26-22-18-14-10-6-2/h21-23,25-27,33-38,73-75,80H,5-20,24,28-32,39-72H2,1-4H3,(H,85,86)(H,87,88)/p-2/b25-21-,26-22-,27-23-,36-33-,37-34-,38-35-/t73?,74-,75-/m1/s1
InChIKeyPPNASYWUDWBRIL-CPPVQQPJSA-L
ChEBI Ontology
Outgoing Relation(s)
1,1',2-trilinoleoyl-2'-palmitoyl cardiolipin(2−) (CHEBI:83583) is a cardiolipin 70:6(2−) (CHEBI:72892)
1,1',2-trilinoleoyl-2'-palmitoyl cardiolipin(2−) (CHEBI:83583) is conjugate base of 1,1',2-trilinoleoyl-2'-palmitoyl cardiolipin (CHEBI:84400)
Incoming Relation(s)
1,1',2-trilinoleoyl-2'-palmitoyl cardiolipin (CHEBI:84400) is conjugate acid of 1,1',2-trilinoleoyl-2'-palmitoyl cardiolipin(2−) (CHEBI:83583)
IUPAC Name 
(2R)-2,3-bis[(9Z,12Z)-octadeca-9,12-dienoyloxy]propyl 2-hydroxypropane-1,3-diyl (2R)-2-(hexadecanoyloxy)-3-[(9Z,12Z)-octadeca-9,12-dienoyloxy]propyl bis(phosphate)
Synonyms  Source
1'-[1,2-dilinoleoyl-sn-glycero-3-phospho]-3'-[1-linoleoyl-2-palmitoyl-sn-glycero-3-phospho]-glycerol(2−)SUBMITTER
1,1',2-trilinoleoyl-2'-palmitoyl CL(2−)SUBMITTER
CL(18:2(9Z,12Z)/18:2(9Z,12Z)/18:2(9Z,12Z)/16:0)(2−)ChEBI
UniProt Name  Source
1'-[1,2-di-(9Z,12Z-octadecadienoyl)-sn-glycero-3-phospho]-3'-[1-(9Z,12Z-octadecadienoyl)-2-hexadecanoyl-sn-glycero-3-phospho]-glycerolUniProt